2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine
TL;DR: 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine (CAS 213609-47-3) is a chemical compound with molecular formula C9H12F2N3O6P and molecular weight 327.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methylphosphonic acid
Also Known As: 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine
| Molecular Formula | C9H12F2N3O6P |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | -1.1032 |
| Topological Polar Surface Area | 147.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.04318 |
| Heavy Atoms | 21 |
| Complexity | 646.6153 |
Chemical Identifiers
| CAS Number | 213609-47-3 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CP(=O)(O)O)O)(F)F |
Product Overview
2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine (CAS 213609-47-3), with molecular formula C9H12F2N3O6P and molecular weight 327.04 g/mol. IUPAC: [(2S,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methylphosphonic acid.
Chemical Property Profile of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine
Property Insights of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine
The XLogP value of -1.1032 indicates that 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.9 Ų indicates high polarity, suggesting 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine?
The CAS number of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine is 213609-47-3.
What is the molecular formula of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine?
The molecular formula of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine is C9H12F2N3O6P.
What is the molecular weight of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine?
The molecular weight of 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine is 327.04 g/mol.
Where can I buy 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine?
You can request a quote for 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine?
Yes, KEHONG BIO provides custom synthesis services for 2',5'-Dideoxy-2',2'-difluoro-5'-phosphonoCytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.